3-methyl-8-nitro-1H-[1,2,4]triazolo[4,3-c]pyrimidine-5,7-dione

Systemtic Name: 3-methyl-8-nitro-1H-[1,2,4]triazolo[4,3-c]pyrimidine-5,7-dione Openeye Name: 3-methyl-8-nitro-1H-[1,2,4]triazolo[4,3-c]pyrimidine-5,7-dione CAS Name: 3-methyl-8-nitro-1H-[1,2,4]triazolo[4,3-c]pyrimidine-5,7-dione IUPAC Name: 3-methyl-8-nitro-1H-[1,2,4]triazolo[4,3-c]pyrimidine-5,7-dione Traditional Name: 3-methyl-8-nitro-1H-[1,2,4]triazolo[4,3-c]pyrimidine-5,7-quinone Formula: C6H5N5O4 MolecularWeight: 211.135

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC2=C(C(=O)NC(=O)N12)[N+](=O)[O-]

Isomeric SMILES

CC1=NNC2=C(C(=O)NC(=O)N12)[N+](=O)[O-]

InChI

InChI=1S/C6H5N5O4/c1-2-8-9-4-3(11(14)15)5(12)7-6(13)10(2)4/h9H,1H3,(H,7,12,13)